N-[1-[(3-cyanophenyl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide hydrochloride

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide hydrochloride Openeye Name: N-[1-[(3-cyanophenyl)methyl]-3-piperidyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide hydrochloride CAS Name: N-[1-[(3-cyanophenyl)methyl]-3-piperidinyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide hydrochloride IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide hydrochloride Traditional Name: N-[1-(3-cyanobenzyl)-3-piperidyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide hydrochloride Formula: C23H27ClN4O MolecularWeight: 410.93968

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC(=C2)C#N)NC(=O)N3CCC4=CC=CC=C4C3.Cl

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC(=C2)C#N)NC(=O)N3CCC4=CC=CC=C4C3.Cl

InChI

InChI=1S/C23H26N4O.ClH/c24-14-18-5-3-6-19(13-18)15-26-11-4-9-22(17-26)25-23(28)27-12-10-20-7-1-2-8-21(20)16-27;/h1-3,5-8,13,22H,4,9-12,15-17H2,(H,25,28);1H